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	hartrees
Energy at 0K	-89.661470
Energy at 298.15K	-89.660556
Nuclear repulsion energy	12.883916

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	-0.876
O2	0.000	0.000	0.438

	Be1	O2
Be1		1.3143
O2	1.3143

All results from a given calculation for BeO (beryllium oxide)

using model chemistry: CID/6-311G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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